N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-3-iodanyl-benzamide

Systemtic Name: N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-3-iodanyl-benzamide Openeye Name: N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-3-iodo-benzamide CAS Name: N-[[4-(1H-benzimidazol-2-yl)anilino]-sulfanylidenemethyl]-3-iodobenzamide IUPAC Name: N-[[4-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-3-iodobenzamide Traditional Name: N-[[4-(1H-benzimidazol-2-yl)phenyl]thiocarbamoyl]-3-iodo-benzamide Formula: C21H15IN4OS MolecularWeight: 498.33947

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)I

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)I

InChI

InChI=1S/C21H15IN4OS/c22-15-5-3-4-14(12-15)20(27)26-21(28)23-16-10-8-13(9-11-16)19-24-17-6-1-2-7-18(17)25-19/h1-12H,(H,24,25)(H2,23,26,27,28)